FUSIDIC ACID HEMIHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	2C31H48O6.H2O
Molecular Weight	1051.4337
Optical Activity	UNSPECIFIED
Defined Stereocenters	20 / 20
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.[H][C@@]12C[C@@H](O)[C@@]3([H])[C@@]4(C)CC[C@@H](O)[C@@H](C)[C@]4([H])CC[C@]3(C)[C@@]1(C)C[C@H](OC(C)=O)\C2=C(\CCC=C(C)C)C(O)=O.[H][C@@]56C[C@@H](O)[C@@]7([H])[C@@]8(C)CC[C@@H](O)[C@@H](C)[C@]8([H])CC[C@]7(C)[C@@]5(C)C[C@H](OC(C)=O)\C6=C(\CCC=C(C)C)C(O)=O

InChI

InChIKey=CSXHKOSAWQTJBT-YDYKLMMDSA-N

InChI=1S/2C31H48O6.H2O/c2*1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32;/h2*9,18,21-25,27,33-34H,8,10-16H2,1-7H3,(H,35,36);1H2/b2*26-20-;/t2*18-,21-,22-,23+,24+,25-,27-,29-,30-,31-;/m00./s1

HIDE SMILES / InChI

Molecular Formula	C31H48O6
Molecular Weight	516.7092
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	1
Optical Activity	UNSPECIFIED

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:17:48 UTC 2023` Edited by `admin` on `Fri Dec 15 17:17:48 UTC 2023`
Record UNII	W540G73230
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

FUSIDIC ACID HEMIHYDRATE

Common Name

English

Fusidic acid hemihydrate [WHO-DD]

Common Name

English

29-NORDAMMARA-17(20),24-DIEN-21-OIC ACID, 16-(ACETYLOXY)-3,11-DIHYDROXY-, HYDRATE (2:1), (3.ALPHA.,4.ALPHA.,8.ALPHA.,9.BETA.,11.ALPHA.,13.ALPHA.,14.BETA.,16.BETA.,17Z)-

Common Name

English

FUSIDIC ACID (HEMIHYDRATE)

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID50169257